Gubbins, K. E.

Authored

(443g) Phase Transitions of Water Confined in Nanopores
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(220h) Can We Define a Unique Microscopic Pressure in Inhomogeneous Fluids?
2020 Virtual AIChE Annual Meeting (ISBN: 978-0-8169-1114-1)
(350b) Bottom-up Approach to the Coarse-Grained Surface Model: Effective Solid-Fluid Potentials for Adsorption on Heterogeneous Surfaces
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(376ai) High-Pressure Phenomena in Adsorbed Films: A New Route to an Experimental Determination of Effective Tangential Pressure
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(746d) Thermodynamics in Reduced Dimensionalities
2019 AIChE Annual Meeting (ISBN: 978-0-8169-1112-7)
(675f) Conformal Sites Model for Adsorbed Films on Energetically Heterogeneous Surface
2017 Annual Meeting (ISBN: 978-0-8169-1102-8)
(109a) Molecular Modeling of Nanoporous Carbons: Atomistic Models and Simulated Adsorption
2010 Annual Meeting
(31a) Thermodynamics and Dynamics of Confined Nano-Phases
2010 Annual Meeting
(523e) Application of the BET Method to Microporous Materials
2010 Annual Meeting
(109d) Quasi-High Pressure Effects in Nanopores
2010 Annual Meeting
(392g) A Reactive Molecular Dynamics Simulation of Hydrogen Sulfide Dissociation Over Graphene Oxide
2011 Annual Meeting
(113f) Molecular Modeling Of Carbon Replica Obtained From Silica Template Using Grand Canonical Monte Carlo Simulations
2007 Annual Meeting
(597a) Development of Realistic Models of MCM-41 Materials for Gas Adsorption Studies
2005 Annual Meeting
(645c) Exploring the Effect of Pore Morphology On Model Electrochemical Double-Layer Capacitor Systems
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(318b) Molecular Dynamics Studies of Diffusion and Solvation of Rubidium Bromide Solutions In Nanoconfinement
2011 Annual Meeting
(432c) Multiscale Simulation Of The Self-Assembly Of Nonionic Poly(Oxyethylene) Alkyl Ether Surfactants
2007 Annual Meeting
(384e) Confinement Effects on the Isomerization Kinetics of Small Hydrocarbons
2005 Annual Meeting
(303c) Pressure Tensor of Fluids in Nanopores of Various Geometries: Molecular Simulation Studies By Mechanical Route and Thermodynamics Route
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(754c) Surface Chemistry of TiO2: Hydrophilic or Hydrophobic
2012 AIChE Annual Meeting
(604f) Diffusion Mechanisms of Fluids Confined in Carbon Nanotubes, Carbon Nanotube Bundles and Hierarchial Carbons: Single-File, Fickian and Dual-Mode Diffusion
2009 Annual Meeting
(42d) A Simulation Study of Capillary Condensation and Freezing of Krypton within Realistic Models of MCM-41 Materials
2005 Annual Meeting
(444c) Understanding Adsorption and Diffusion In Disordered Nanoporous Carbons
2011 Annual Meeting
(185e) A Double Exponential Effect Of Confinement On Reaction Rates
2007 Annual Meeting
(597c) Modeling Porous Carbons by Reverse Monte Carlo and Simultaneous Energy Minimization
2005 Annual Meeting
(687a) Controllable Phase Transition of CuBTC Metal-Organic Framework and Its Application in CO2 Capture and Storage
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(665j) Atomistic Models of Activated Carbons
2009 Annual Meeting
(39b) Methane Decomposition Over Graphene Edges For Co And CO2-Free Hydrogen Production
2007 Annual Meeting
(309d) From Atomistic to Mesoscale Models: Coarse-Graining Techniques
2005 Annual Meeting
(242f) High Pressure Effects In Nanopores
2011 Annual Meeting
(250b) A Monte Carlo Study of Gas Adsorption on Atomistic Models of Templated Mesoporous Silicas
2007 Annual Meeting
(223b) Water Adsorption Isotherms in Molecularly Reconstructed Models of Activated and Un-Activated Carbons Obtained from Saccharose
2005 Annual Meeting
(559b) Ammonia Adsorption On Cu-MOF: a Molecular Simulation Approach
2011 Annual Meeting
(630f) Sequestration and Selective Oxidation of Carbon Monoxide on Graphene Edges
2007 Annual Meeting
(356g) Catalytic Role of Defective Carbon Substrates in the Dissociation of Water
2005 Annual Meeting
(299g) Confinement Effect on Chemical Reaction Yield: The Nitric Oxide Dimer Reaction
2016 AIChE Annual Meeting (ISBN: 978-0-8169-1097-7)
(505d) The Search for High-Pressure Ice Phases in Nanoconfined Water Via Molecular Simulation
2013 AIChE Annual Meeting (ISBN: 978-0-8169-1110-3)
(228a) Solvation Structure of Ions in Model Disordered Carbon Electrodes
2012 AIChE Annual Meeting
(178r) Anomalous and Single-File Diffusion for Fluids Confined in Microporous Carbons: Activated Carbon, Carbon Replicas, and Carbon Nanotube Systems
2009 Annual Meeting
(28h) Coarse-Grained Potentials from Widom's Particle Insertion Method
2005 Annual Meeting
(559a) Molecular Models of Mcf and Sba-15 and Gas Adsorption: a Molecular Simulation Study
2005 Annual Meeting

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2005 Annual Meeting2007 Annual Meeting2009 Annual Meeting2010 Annual Meeting2011 Annual Meeting2012 AIChE Annual Meeting2013 AIChE Annual Meeting2016 AIChE Annual Meeting2017 Annual Meeting2019 AIChE Annual Meeting2020 Virtual AIChE Annual Meeting